1-hexadecoxy-3-[4-[[3-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]propan-2-ol

Systemtic Name: 1-hexadecoxy-3-[4-[[3-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]propan-2-ol Openeye Name: 1-hexadecoxy-3-[4-[[3-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]propan-2-ol CAS Name: 1-hexadecoxy-3-[4-[[3-(trifluoromethyl)phenyl]methyl]-1-piperazinyl]-2-propanol IUPAC Name: 1-hexadecoxy-3-[4-[[3-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]propan-2-ol Traditional Name: 1-cetyloxy-3-[4-[3-(trifluoromethyl)benzyl]piperazino]propan-2-ol Formula: C31H53F3N2O2 MolecularWeight: 542.75993

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOCC(CN1CCN(CC1)CC2=CC(=CC=C2)C(F)(F)F)O

Isomeric SMILES

CCCCCCCCCCCCCCCCOCC(CN1CCN(CC1)CC2=CC(=CC=C2)C(F)(F)F)O

InChI

InChI=1S/C31H53F3N2O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-23-38-27-30(37)26-36-21-19-35(20-22-36)25-28-17-16-18-29(24-28)31(32,33)34/h16-18,24,30,37H,2-15,19-23,25-27H2,1H3